CID 66771371

1252760-19-2

Structural Information

Molecular Formula
C10H9ClO3
SMILES
C1CC1(C(=O)O)OC2=CC=C(C=C2)Cl
InChI
InChI=1S/C10H9ClO3/c11-7-1-3-8(4-2-7)14-10(5-6-10)9(12)13/h1-4H,5-6H2,(H,12,13)
InChIKey
BVOVUSTVSOEJLN-UHFFFAOYSA-N
Compound name
1-(4-chlorophenoxy)cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

212.02402 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.031296 138.4
[M+Na]+ 235.013238 148.9
[M-H]- 211.016744 145.1
[M+NH4]+ 230.057843 154.4
[M+K]+ 250.987178 145.5
[M+H-H2O]+ 195.021280 134.2
[M+HCOO]- 257.022221 156.9
[M+CH3COO]- 271.037871 184.1
[M+Na-2H]- 232.998686 145.1
[M]+ 212.02347142 143.7
[M]- 212.02456858 143.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe